N-[(E)-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]methylideneamino]-4-nitro-benzamide

Systemtic Name: N-[(E)-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]methylideneamino]-4-nitro-benzamide Openeye Name: N-[(E)-[4-methoxy-3-(morpholinomethyl)phenyl]methyleneamino]-4-nitro-benzamide CAS Name: N-[(E)-[4-methoxy-3-(4-morpholinylmethyl)phenyl]methylideneamino]-4-nitrobenzamide IUPAC Name: N-[(E)-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]methylideneamino]-4-nitrobenzamide Traditional Name: N-[(E)-[4-methoxy-3-(morpholinomethyl)benzylidene]amino]-4-nitro-benzamide Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CN3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CN3CCOCC3

InChI

InChI=1S/C20H22N4O5/c1-28-19-7-2-15(12-17(19)14-23-8-10-29-11-9-23)13-21-22-20(25)16-3-5-18(6-4-16)24(26)27/h2-7,12-13H,8-11,14H2,1H3,(H,22,25)/b21-13+